5-(2-fluorophenyl)thiomorpholin-3-one

C10H10FNOS — CID 105464971

IUPAC5-(2-fluorophenyl)thiomorpholin-3-one
SMILESO=C1CSCC(c2ccccc2F)N1
InChIInChI=1S/C10H10FNOS/c11-8-4-2-1-3-7(8)9-5-14-6-10(13)12-9/h1-4,9H,5-6H2,(H,12,13)
InChIKeyUYFNWKNGSLZMLT-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.73
Rot. Bonds1

About 5-(2-fluorophenyl)thiomorpholin-3-one

5-(2-fluorophenyl)thiomorpholin-3-one (PubChem CID 105464971) has the molecular formula C10H10FNOS and a molecular weight of 211.26 g/mol. Its IUPAC name is 5-(2-fluorophenyl)thiomorpholin-3-one.

Molecular Properties

Compound Name5-(2-fluorophenyl)thiomorpholin-3-one
PubChem CID105464971
Molecular FormulaC10H10FNOS
Molecular Weight211.26 g/mol
Exact Mass211.05
IUPAC Name5-(2-fluorophenyl)thiomorpholin-3-one
SMILESO=C1CSCC(c2ccccc2F)N1
InChIInChI=1S/C10H10FNOS/c11-8-4-2-1-3-7(8)9-5-14-6-10(13)12-9/h1-4,9H,5-6H2,(H,12,13)
InChIKeyUYFNWKNGSLZMLT-UHFFFAOYSA-N
XLogP1.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-fluorophenyl)-1,4-thiazepane
CID 66219257
3-(2-fluorophenyl)-5-methyl-1,4-thiazepane
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4-(aminomethyl)-6-(2-fluorophenyl)piperidin-2-one
CID 105479086
2-(2-fluorophenyl)-2,3-dihydro-1H-quinolin-4-one
CID 11218695
ethane;3-fluoro-6-(2-fluorophenyl)piperidin-2-one
CID 145079036
5-(2-fluorophenyl)-4-(trifluoromethyl)pyrrolidin-2-one
CID 145101919
(4R)-4-(2-fluorophenyl)-1,3-oxazinan-2-one;hydrochloride
CID 171184835
N-[(2-fluorophenyl)methyl]-5-oxothiomorpholine-3-carboxamide
CID 110695445
5-(4-methoxyphenyl)thiomorpholin-3-one
CID 105480891
(2R)-2-(2-fluorophenyl)pyrrolidine;methane
CID 161076171
(2S)-2-(2-fluorophenyl)pyrrolidine;hydrochloride
CID 66518510
2-(2-fluorophenyl)-4-methylazetidine
CID 116822055

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)thiomorpholin-3-one?
The IUPAC name of 5-(2-fluorophenyl)thiomorpholin-3-one (CID 105464971) is 5-(2-fluorophenyl)thiomorpholin-3-one.
What is the SMILES notation for 5-(2-fluorophenyl)thiomorpholin-3-one?
The canonical SMILES for 5-(2-fluorophenyl)thiomorpholin-3-one is O=C1CSCC(c2ccccc2F)N1.
What is the InChIKey of 5-(2-fluorophenyl)thiomorpholin-3-one?
The InChIKey is UYFNWKNGSLZMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNOS/c11-8-4-2-1-3-7(8)9-5-14-6-10(13)12-9/h1-4,9H,5-6H2,(H,12,13).
What are the key properties of 5-(2-fluorophenyl)thiomorpholin-3-one?
5-(2-fluorophenyl)thiomorpholin-3-one has a molecular weight of 211.26 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)thiomorpholin-3-one is sourced from PubChem (CID 105464971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).